faec8ac2be
correctly update dihedral constraint
2020-05-23 23:22:56 -06:00
4250def29a
dihedral constraint: fragment support
2020-05-23 22:58:37 -06:00
74d58778b4
angle constraint: fragment support
2020-05-23 22:29:14 -06:00
a64a9c1253
distance constraint: fragment support
2020-05-23 22:13:20 -06:00
d946c61789
re-indent code to better match LAMMPS conventions
2020-04-26 23:25:52 -04:00
6baca04447
round up 'nevery' variable eval
2020-04-26 12:45:42 -06:00
a614242595
allow variable-input for Nevery, Rmin, Rmax keywords
2020-04-25 21:45:43 -06:00
0288bb4b6b
small modification to fix bond/react to allow equal style variables as probability o
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On branch master
Your branch is up to date with 'origin/master'.
Changes to be committed:
modified: doc/src/fix_bond_react.rst
new file: examples/USER/reaction/nylon,6-6_melt/in.large_nylon_melt_variable_probability
modified: src/USER-REACTION/fix_bond_react.cpp
modified: src/USER-REACTION/fix_bond_react.h
2020-04-22 13:27:10 +02:00
649a8cc01a
Fix typo
2020-03-14 13:57:48 +09:00
244828d193
add map IDs check to dihedral constraint
2020-02-02 18:05:27 -07:00
a35dc180bd
bond/react: dihedral reaction constraint
2020-01-30 00:28:59 -07:00
d897949ff8
bond/react: check for valid IDs in map file
2020-01-21 23:21:41 -07:00
c3922c7e35
rename package USER-REACTION
2020-01-09 20:07:41 -07:00
